SCHEMBL28294841

SCHEMBL28294841

CSC[C@@H]1[C@H](O)[C@@H](COC(C)(C)C)O[C@]1(n1ccc(N)nc1=O)[SiH](C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
MTOR P42345 1/20 0.33
MDM2 Q00987 1/20 0.33
NCOA1 Q15788 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
PDE4D Q08499 1/20 0.32
PDE3A Q14432 1/20 0.32
SLC29A1 Q99808 1/20 0.32
POLA1 P09884 1/20 0.31
TSHR P16473 1/20 0.30
GLA P06280 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28294920 0.86 L3MBTL1 (0.36) LMNATHRBMTORMDM2NCOA1
SCHEMBL28294844 0.81 LMNA (0.34) LMNATHRBMTORMDM2NCOA1
SCHEMBL28294847 0.79 HINT1 (0.41) TSHR
SCHEMBL25390814 0.77 PDE4D (0.38) LMNATHRBMTORMDM2NCOA1
SCHEMBL28293053 0.76
SCHEMBL28293078 0.76 TK1 (0.32)
SCHEMBL6761673 0.76 POLA1 (0.31) POLA1
SCHEMBL10613710 0.75 PDE3A (0.36) LMNATHRBMTORMDM2NCOA1
SCHEMBL7776536 0.73 LMNA (0.44) LMNATHRBMTORMDM2NCOA1
SCHEMBL17223095 0.72 TYMP (0.41)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109661232-A NUCLEOTIDE DERIVATIVES AND METHODS OF USE THEREOF 纽约哥伦比亚大学董事会 2019-04-19 CN disclosed